Geometry & MOs

Info

ID:	247051
PubChem CID:	103066935
Reduced:	ClNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	347.98763
ΔH_f, kcal/mol:	-55.63
Dipole, Da:	3.57
IP(EA), eV:	-8.55(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bromo-4-chloro-6-nitrophenoxy)methyl]-N-ethylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OCC(=C)CNC(C)(C)C

DOS

IR

Vibrations